HTTP 200 OK
Allow: GET, HEAD, OPTIONS
Content-Type: application/json
Vary: Accept
{
"count": 55712,
"next": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=chemical_system&page=300",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=chemical_system&page=298",
"results": [
{
"id": "jvasp-29781",
"created_at": "2022-09-04T14:38:02.080136Z",
"updated_at": "2022-09-04T14:38:02.080165Z",
"structure_string": "Al2 H2 O4\n1.0\n1.446400 6.032243 0.000000\n-1.446400 6.032243 0.000000\n0.000000 0.000000 3.728927\nAl H O\n2 2 4\ndirect\n0.680503 0.680503 0.249858 Al\n0.319497 0.319497 0.749859 Al\n0.019234 0.019234 0.441038 H\n0.980765 0.980765 0.941038 H\n0.290816 0.290816 0.250543 O\n0.709183 0.709183 0.750543 O\n0.077672 0.077672 0.247277 O\n0.922327 0.922327 0.747277 O\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Al",
"H",
"O"
],
"chemical_system": "Al-H-O",
"density": 3.0617122694065926,
"density_atomic": 0.12294443307701343,
"volume": 65.07004668514541,
"volume_molar": 4.898262254971463,
"formula_full": "Al2 H2 O4",
"formula_reduced": "AlHO2",
"formula_anonymous": "ABC2",
"energy_above_hull": 1.64766745,
"spacegroup": 36
},
{
"id": "jvasp-29782",
"created_at": "2022-09-04T14:38:02.356934Z",
"updated_at": "2022-09-04T14:38:02.356961Z",
"structure_string": "Al2 H2 O4\n1.0\n1.446339 6.032286 0.000000\n-1.446339 6.032286 0.000000\n0.000000 0.000000 3.729102\nAl H O\n2 2 4\ndirect\n0.680501 0.680501 0.248080 Al\n0.319500 0.319500 0.748080 Al\n0.019233 0.019233 0.439298 H\n0.980767 0.980767 0.939298 H\n0.290819 0.290819 0.248748 O\n0.709182 0.709182 0.748748 O\n0.077666 0.077666 0.245527 O\n0.922335 0.922335 0.745526 O\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Al",
"H",
"O"
],
"chemical_system": "Al-H-O",
"density": 3.0616758871061096,
"density_atomic": 0.12294297212937587,
"volume": 65.07081992113714,
"volume_molar": 4.89832046167125,
"formula_full": "Al2 H2 O4",
"formula_reduced": "AlHO2",
"formula_anonymous": "ABC2",
"energy_above_hull": 1.64767495,
"spacegroup": 36
},
{
"id": "jvasp-29835",
"created_at": "2022-09-04T14:38:03.802576Z",
"updated_at": "2022-09-04T14:38:03.802594Z",
"structure_string": "Al4 H12 O12\n1.0\n-4.270157 2.306343 4.734391\n4.443693 -2.397212 5.434028\n4.213273 2.493427 -6.444171\nAl H O\n4 12 12\ndirect\n0.453484 0.836496 0.288921 Al\n0.508805 0.165795 0.681056 Al\n0.972206 0.671530 0.638915 Al\n0.990085 0.330752 0.331059 Al\n0.791297 0.599363 0.812110 H\n0.170986 0.402926 0.157855 H\n0.658206 0.909663 0.151817 H\n0.616024 0.830747 0.674302 H\n0.346204 0.171515 0.295633 H\n0.304104 0.092613 0.818159 H\n0.153660 0.715742 0.459939 H\n0.380158 0.466408 0.060222 H\n0.582132 0.535885 0.909766 H\n0.911464 0.945172 0.111534 H\n0.050826 0.057124 0.858439 H\n0.808570 0.286543 0.509982 H\n0.507942 0.190216 0.915555 O\n0.454351 0.812073 0.054420 O\n0.434272 0.868453 0.524027 O\n0.528010 0.133849 0.445951 O\n0.938074 0.389727 0.540407 O\n0.501060 0.439137 0.727219 O\n0.461221 0.563154 0.242763 O\n0.002992 0.059090 0.294726 O\n0.959293 0.943197 0.675248 O\n0.010713 0.284309 0.088475 O\n0.024199 0.612559 0.429549 O\n0.951580 0.717975 0.881501 O\n",
"nsites": 28,
"nelements": 3,
"elements": [
"Al",
"H",
"O"
],
"chemical_system": "Al-H-O",
"density": 2.455327214649888,
"density_atomic": 0.13269174455988397,
"volume": 211.0153882810966,
"volume_molar": 4.538444181267208,
"formula_full": "Al4 H12 O12",
"formula_reduced": "Al(HO)3",
"formula_anonymous": "AB3C3",
"energy_above_hull": 2.4481219000000003,
"spacegroup": 2
},
{
"id": "jvasp-30387",
"created_at": "2022-09-04T14:37:56.204651Z",
"updated_at": "2022-09-04T14:37:56.204676Z",
"structure_string": "Al4 H12 O12\n1.0\n5.046184 0.000000 0.653385\n0.000000 8.706653 0.000000\n0.588161 0.000000 4.752855\nAl H O\n4 12 12\ndirect\n0.045451 0.333994 0.970986 Al\n0.454548 0.833994 0.029015 Al\n0.545451 0.166006 0.970985 Al\n0.954547 0.666006 0.029014 Al\n0.771638 0.181060 0.388796 H\n0.875225 0.958500 0.785919 H\n0.726924 0.883434 0.394675 H\n0.624773 0.458501 0.214080 H\n0.728360 0.681060 0.611204 H\n0.773075 0.383434 0.605325 H\n0.375226 0.541499 0.785920 H\n0.273075 0.116566 0.605326 H\n0.226924 0.616565 0.394675 H\n0.124774 0.041499 0.214081 H\n0.228361 0.818939 0.611204 H\n0.271639 0.318939 0.388797 H\n0.697989 0.802575 0.261779 O\n0.802010 0.302575 0.738221 O\n0.677048 0.669349 0.821746 O\n0.688016 0.981535 0.773784 O\n0.311983 0.018465 0.226216 O\n0.302010 0.197425 0.738222 O\n0.197989 0.697424 0.261779 O\n0.177048 0.830650 0.821747 O\n0.188017 0.518465 0.773784 O\n0.822951 0.169349 0.178253 O\n0.322951 0.330650 0.178254 O\n0.811982 0.481535 0.226216 O\n",
"nsites": 28,
"nelements": 3,
"elements": [
"Al",
"H",
"O"
],
"chemical_system": "Al-H-O",
"density": 2.521562504170556,
"density_atomic": 0.13627125773657459,
"volume": 205.47252931448455,
"volume_molar": 4.4192303351609015,
"formula_full": "Al4 H12 O12",
"formula_reduced": "Al(HO)3",
"formula_anonymous": "AB3C3",
"energy_above_hull": 2.448803328571429,
"spacegroup": 14
},
{
"id": "jvasp-54695",
"created_at": "2022-09-04T14:37:54.987906Z",
"updated_at": "2022-09-04T14:37:54.987940Z",
"structure_string": "Al4 H4 O8\n1.0\n2.874277 -0.000000 0.000000\n0.000000 4.920564 0.000000\n0.000000 0.000000 8.470826\nAl H O\n4 4 8\ndirect\n0.250000 0.387499 0.647164 Al\n0.250000 0.112500 0.147164 Al\n0.750001 0.612500 0.352837 Al\n0.750001 0.887499 0.852837 Al\n0.750001 0.366669 0.923083 H\n0.750001 0.133331 0.423082 H\n0.250000 0.633330 0.076918 H\n0.250000 0.866669 0.576918 H\n0.750001 0.209471 0.000826 O\n0.750001 0.290529 0.500826 O\n0.250000 0.790528 0.999175 O\n0.250000 0.709470 0.499174 O\n0.750001 0.958543 0.260656 O\n0.750001 0.541455 0.760656 O\n0.250000 0.041456 0.739345 O\n0.250000 0.458544 0.239345 O\n",
"nsites": 16,
"nelements": 3,
"elements": [
"Al",
"H",
"O"
],
"chemical_system": "Al-H-O",
"density": 3.3258773007168703,
"density_atomic": 0.13355209870834603,
"volume": 119.80343367677918,
"volume_molar": 4.509207132080554,
"formula_full": "Al4 H4 O8",
"formula_reduced": "AlHO2",
"formula_anonymous": "ABC2",
"energy_above_hull": 1.6474824499999998,
"spacegroup": 62
},
{
"id": "jvasp-113650",
"created_at": "2022-09-04T14:38:48.523604Z",
"updated_at": "2022-09-04T14:38:48.523624Z",
"structure_string": "Al1 H1 O1\n1.0\n4.779324 0.988332 0.000000\n-0.643031 2.990091 0.000000\n0.000000 0.000000 4.046909\nAl H O\n1 1 1\ndirect\n0.388954 0.167337 0.000000 Al\n0.066122 0.163366 0.000000 H\n0.544923 0.669296 0.000000 O\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Al",
"H",
"O"
],
"chemical_system": "Al-H-O",
"density": 1.2092636168305189,
"density_atomic": 0.04966497863178114,
"volume": 60.404737556461335,
"volume_molar": 12.125527737862287,
"formula_full": "Al1 H1 O1",
"formula_reduced": "AlHO",
"formula_anonymous": "ABC",
"energy_above_hull": 1.542448766666667,
"spacegroup": 25
},
{
"id": "jvasp-113647",
"created_at": "2022-09-04T14:38:46.693413Z",
"updated_at": "2022-09-04T14:38:46.693438Z",
"structure_string": "Al1 H1 O2\n1.0\n1.391666 0.803479 4.301392\n-1.391666 0.803479 4.301392\n-0.000000 -1.606957 4.301392\nAl H O\n1 1 2\ndirect\n0.500000 0.500000 0.500000 Al\n0.000000 0.000000 0.000000 H\n0.245128 0.245128 0.245128 O\n0.754872 0.754872 0.754872 O\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Al",
"H",
"O"
],
"chemical_system": "Al-H-O",
"density": 3.451801845072441,
"density_atomic": 0.13860865541714396,
"volume": 28.85822669559823,
"volume_molar": 4.344707581122056,
"formula_full": "Al1 H1 O2",
"formula_reduced": "AlHO2",
"formula_anonymous": "ABC2",
"energy_above_hull": 1.86460495,
"spacegroup": 166
},
{
"id": "jvasp-113653",
"created_at": "2022-09-04T14:38:46.720353Z",
"updated_at": "2022-09-04T14:38:46.720370Z",
"structure_string": "Al2 H2 O2\n1.0\n3.376998 0.000000 0.000000\n0.000000 3.376998 0.000000\n0.000000 -0.000000 4.587941\nAl H O\n2 2 2\ndirect\n0.000000 0.500000 0.694159 Al\n0.500000 0.000000 0.305840 Al\n0.000000 0.000000 0.000000 H\n0.500000 0.500000 0.000000 H\n0.500000 0.500000 0.500000 O\n0.000000 0.000000 0.500000 O\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Al",
"H",
"O"
],
"chemical_system": "Al-H-O",
"density": 2.7921744753876663,
"density_atomic": 0.1146758107382706,
"volume": 52.32140903450032,
"volume_molar": 5.251448166121611,
"formula_full": "Al2 H2 O2",
"formula_reduced": "AlHO",
"formula_anonymous": "ABC",
"energy_above_hull": 1.5139621000000003,
"spacegroup": 129
},
{
"id": "jvasp-113646",
"created_at": "2022-09-04T14:38:47.997522Z",
"updated_at": "2022-09-04T14:38:47.997545Z",
"structure_string": "Al1 H1 O1\n1.0\n3.364259 -0.000000 -0.000000\n-1.682130 2.913534 -0.000000\n0.000000 0.000000 3.845451\nAl H O\n1 1 1\ndirect\n0.000000 0.000000 0.000000 Al\n0.333333 0.666666 0.000000 H\n0.666667 0.333333 0.000000 O\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Al",
"H",
"O"
],
"chemical_system": "Al-H-O",
"density": 1.937917091305229,
"density_atomic": 0.07959109129744607,
"volume": 37.69266071234614,
"volume_molar": 7.566350280955678,
"formula_full": "Al1 H1 O1",
"formula_reduced": "AlHO",
"formula_anonymous": "ABC",
"energy_above_hull": 1.783688766666667,
"spacegroup": 187
},
{
"id": "jvasp-113649",
"created_at": "2022-09-04T14:38:45.530436Z",
"updated_at": "2022-09-04T14:38:45.530463Z",
"structure_string": "Al1 H2 O2\n1.0\n2.911883 0.000000 -0.000000\n-1.455942 2.521765 0.000000\n-0.000000 -0.000000 5.721107\nAl H O\n1 2 2\ndirect\n0.000000 0.000000 0.000000 Al\n0.666665 0.333333 0.357368 H\n0.333332 0.666666 0.642632 H\n0.333332 0.666666 0.835522 O\n0.666665 0.333333 0.164479 O\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Al",
"H",
"O"
],
"chemical_system": "Al-H-O",
"density": 2.410978877755766,
"density_atomic": 0.1190176580573275,
"volume": 42.01057289828068,
"volume_molar": 5.0598716680337485,
"formula_full": "Al1 H2 O2",
"formula_reduced": "Al(HO)2",
"formula_anonymous": "AB2C2",
"energy_above_hull": 2.19427796,
"spacegroup": 164
},
{
"id": "jvasp-54772",
"created_at": "2022-09-04T14:37:02.933952Z",
"updated_at": "2022-09-04T14:37:02.933976Z",
"structure_string": "Al10 H2 O16\n1.0\n5.628450 -0.000000 -0.000000\n-2.814225 4.874424 0.000000\n-0.000000 0.000001 8.827760\nAl H O\n10 2 16\ndirect\n0.834308 0.165676 0.865668 Al\n0.666666 0.333332 0.547733 Al\n0.666673 0.333344 0.158679 Al\n0.333328 0.666655 0.658679 Al\n0.668632 0.834323 0.365669 Al\n0.333334 0.666667 0.047733 Al\n0.165693 0.834323 0.365669 Al\n0.331368 0.165675 0.865668 Al\n0.834308 0.668615 0.865671 Al\n0.165692 0.331384 0.365672 Al\n-0.000006 -0.000013 0.597771 H\n0.000006 0.000012 0.097771 H\n0.668181 0.834080 0.762644 O\n0.834104 0.668206 0.262636 O\n0.834100 0.165920 0.262644 O\n0.331820 0.165920 0.262644 O\n0.165897 0.331793 0.762637 O\n0.165900 0.834080 0.762644 O\n0.970995 0.485491 0.000977 O\n-0.000002 -0.000004 0.985262 O\n0.514497 0.485491 0.000977 O\n0.029006 0.514508 0.500977 O\n0.485498 0.970995 0.500978 O\n0.485503 0.514508 0.500977 O\n0.666662 0.333324 0.754739 O\n0.000002 0.000004 0.485262 O\n0.514502 0.029004 0.000978 O\n0.333338 0.666675 0.254738 O\n",
"nsites": 28,
"nelements": 3,
"elements": [
"Al",
"H",
"O"
],
"chemical_system": "Al-H-O",
"density": 3.6188757908820763,
"density_atomic": 0.11560999914865686,
"volume": 242.19358365357536,
"volume_molar": 5.209013756895236,
"formula_full": "Al10 H2 O16",
"formula_reduced": "Al5HO8",
"formula_anonymous": "AB5C8",
"energy_above_hull": 2.4551301428571426,
"spacegroup": 186
},
{
"id": "jvasp-113651",
"created_at": "2022-09-04T14:38:50.723380Z",
"updated_at": "2022-09-04T14:38:50.723402Z",
"structure_string": "Al1 H1 O2\n1.0\n1.437132 0.829729 4.463063\n-1.437132 0.829729 4.463063\n0.000000 -1.659457 4.463063\nAl H O\n1 1 2\ndirect\n0.003875 0.003875 0.003875 Al\n0.514036 0.514036 0.514036 H\n0.403209 0.403209 0.403209 O\n0.592278 0.592278 0.592278 O\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Al",
"H",
"O"
],
"chemical_system": "Al-H-O",
"density": 3.119596861920064,
"density_atomic": 0.1252688149209814,
"volume": 31.93133105412683,
"volume_molar": 4.807374256552773,
"formula_full": "Al1 H1 O2",
"formula_reduced": "AlHO2",
"formula_anonymous": "ABC2",
"energy_above_hull": 1.64884995,
"spacegroup": 160
}
]
}